In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 35 | No |
Popular Name: [4-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-nitro-phenyl]BLAHdione [4-[4-[(4-chlorophenyl)methyl]pi…
None
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) | 4.50 | 15.52 | -59.21 | 1 | 8 | 1 | 91 | 493.971 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.50 | 13.28 | -16.05 | 0 | 8 | 0 | 90 | 492.963 | 5 | ↓ |