In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 32 | No |
Popular Name: N-[5-[(4-chlorophenyl)methyl]thiazol-2-yl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide N-[5-[(4-chlorophenyl)methyl]thi…
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) | 4.64 | 13.43 | -69.92 | 2 | 8 | 1 | 95 | 472.978 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.71 | 10.04 | -43.9 | 0 | 8 | -1 | 101 | 470.962 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.64 | 10.96 | -24.54 | 1 | 8 | 0 | 94 | 471.97 | 6 | ↓ |