In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2007 | 32 | No |
Popular Name: 1-(3-dimethylaminopropyl)-3-hydroxy-4-(3-methoxybenzoyl)-5-(4-nitrophenyl)-5H-pyrrol-2-one 1-(3-dimethylaminopropyl)-3-hydr…
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) | 2.67 | 9.76 | -63.35 | 2 | 9 | 1 | 117 | 440.476 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.09 | 10.42 | -76.01 | 1 | 9 | 1 | 114 | 440.476 | 9 | ↓ |