In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 18 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.50 | 4.44 | -31.41 | 2 | 3 | 1 | 20 | 252.426 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.50 | 6.84 | -98.34 | 3 | 3 | 2 | 21 | 253.434 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.50 | 8.18 | -189.22 | 4 | 3 | 3 | 25 | 254.442 | 2 | ↓ |