In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2010 | 27 | Yes |
Popular Name: N-[(2S)-2-(4-methylpiperazin-1-yl)-3-phenyl-propyl]-3-phenyl-propanamide N-[(2S)-2-(4-methylpiperazin-1-y…
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) | 3.45 | 10.38 | -40.23 | 2 | 4 | 1 | 37 | 366.529 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.45 | 8 | -9.08 | 1 | 4 | 0 | 36 | 365.521 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.45 | 10.65 | -40.55 | 2 | 4 | 1 | 37 | 366.529 | 8 | ↓ |