In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 26 | Yes |
Popular Name: (4S)-N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-4-(4-methylpiperazin-1-yl)pentanamide (4S)-N-[2-(3,5-dimethylphenoxy)e…
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) | 2.96 | 10.08 | -43.6 | 1 | 5 | 1 | 37 | 362.538 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.96 | 7.71 | -10.92 | 0 | 5 | 0 | 36 | 361.53 | 8 | ↓ |