In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 31 | Yes |
Popular Name: N-[6-[4-[(3,5-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]-2,2-dimethyl-propanamide N-[6-[4-[(3,5-dimethoxyphenyl)me…
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) | 3.79 | 10.42 | -43.3 | 2 | 7 | 1 | 68 | 427.569 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.79 | 10.74 | -98.22 | 3 | 7 | 2 | 69 | 428.577 | 7 | ↓ |