In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2009 | 23 | Yes |
Popular Name: N-(3-chlorophenyl)-4-(2-thienylmethyl)-1,4-diazepane-1-carboxamide N-(3-chlorophenyl)-4-(2-thienylm…
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) | 3.80 | 10.7 | -47 | 2 | 4 | 1 | 37 | 350.895 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.80 | 8.8 | -8.61 | 1 | 4 | 0 | 36 | 349.887 | 3 | ↓ |