In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 21 | Yes |
Popular Name: N-[2-(aminomethyl)phenyl]-3-(4-methyl-1,4-diazepan-1-yl)propanamide N-[2-(aminomethyl)phenyl]-3-(4-m…
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) | 0.72 | 4.34 | -111.14 | 5 | 5 | 2 | 64 | 292.427 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.72 | 4.05 | -112.28 | 5 | 5 | 2 | 64 | 292.427 | 5 | ↓ |