In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2009 | 27 | Yes |
Popular Name: 4-benzhydryl-N-(2-dimethylaminoethyl)piperazine-1-carboxamide 4-benzhydryl-N-(2-dimethylaminoe…
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) | 3.64 | 10.17 | -44.51 | 2 | 5 | 1 | 40 | 367.517 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.64 | 7.63 | -10.42 | 1 | 5 | 0 | 39 | 366.509 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.64 | 11.83 | -96.18 | 3 | 5 | 2 | 41 | 368.525 | 6 | ↓ |