Kaempferol
IUPAC NAme: -
CAS Number: 520-18-3
Class: -
Plants contain this compound
5 plants
| HerbID |
Thai name |
Common name |
Scientific name |
Family |
| 28 |
ขี้เหล็ก |
- |
Senna siamea (Lam.) H.S.Irwin & Barneby |
Caesalpiniaceae |
| 28 |
ขี้เหล็ก |
- |
Senna siamea (Lam.) H.S.Irwin & Barneby |
Fabaceae |
| 35 |
ชุมเห็ดเทศ |
- |
Cassia alata (L.) Roxb. |
Fabaceae |
| 35 |
ชุมเห็ดเทศ |
- |
Cassia alata (L.) Roxb. |
Leguminosae-Caesalpinioideae |
| 48 |
ตีนเป็ดฝรั่ง |
- |
Crescentia alata HBK |
Bignoniaceae |
| 51 |
ทองกวาว |
- |
Butea monosperma (Lam.) Taub. |
Fabaceae |
| 67 |
เทียนข้าวเปลือก |
- |
Foeniculum vulgare Mill. |
Umbelliferae |
| 67 |
เทียนดำ |
- |
Nigella sativa L. |
Ranunculaceae |
2D Structure
Compound Properties
Smile
OC1=CC=C(C=C1)C1=C(O)C(=O)C2=C(O1)C=C(O)C=C2O
Physicochemical Properties
| Formula |
C15H10O6 |
| Molecular wieght(g/mol) |
286.24 |
| Num. of Heavy atoms |
21 |
| Num. of Aromatic Heavy atoms |
16 |
| Fraction Csp3 |
0.00 |
| Num. of Rotatable bonds |
1 |
| Num. of H-bond acceptors |
6 |
| Num. of H-bonds donors |
4 |
| Molar Refractivity |
76.01 |
| TPSA (square Angstrom) |
111.13 |
Lipophilicity
| iLOGP |
1.70 |
| XLOGP3 |
1.90 |
| WLOGP |
2.28 |
| MLOGP |
-0.03 |
| Silicos-IT LOGP |
2.03 |
| Consensus LOGP |
1.58 |
Water Solubility
| ESOL |
|
| LogS |
-3.31 |
Solubility(mg/ml) |
1.40E-01 |
Solubility(mol/l) |
4.90E-04 |
Class |
Soluble |
| Ali |
|
| LogS |
-3.86 |
Solubility(mg/ml) |
3.98E-02 |
Solubility(mol/l) |
1.39E-04 |
Class |
Soluble |
| Silicos-IT |
|
| LogS |
-3.82 |
Solubility(mg/ml) |
4.29E-02 |
Solubility(mol/l) |
1.50E-04 |
Class |
Soluble |
Pharmacokinetics
| GI absorbtion |
High |
| BBB permeant |
No |
| Pgp substrate |
No |
| CYP1A2 inhibitor |
Yes |
| CYP2C19 inhibitor |
No |
| CYP2C9 inhibitor |
No |
| CYP2D6 inhibitor |
Yes |
| CYP3A4 inhibitor |
Yes |
| Log Kp (skin permeation) (cm/s) |
-6.70 |
Druglikeness
| Lipinski Num. violations |
0 |
| Ghose Num. violations |
0 |
| Veber Num. violations |
0 |
| Egan Num. violations |
0 |
| Muegge Num. violations |
0 |
| Bioavailability Score |
0.55 |
Medicinal Chemistry
| PAINS Num. of alerts |
0 |
| Brenk Num. of alerts |
0 |
| Leadlikeness Num. of violations |
0 |
| Synthetic Accessibility |
3.14 |
