In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2010 | 24 | No |
Popular Name: 3-(4-ethylpiperazin-1-yl)-N-(4-methoxy-2-nitro-phenyl)propanamide 3-(4-ethylpiperazin-1-yl)-N-(4-m…
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) | 1.63 | 5.96 | -39.66 | 2 | 8 | 1 | 92 | 337.4 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.63 | 3.68 | -8.03 | 1 | 8 | 0 | 91 | 336.392 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 5.95 | -44.49 | 2 | 8 | 1 | 92 | 337.4 | 7 | ↓ |