In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: (1S)-N-cyclopentyl-N-methyl-1-(1-naphthyl)ethane-1,2-diamine (1S)-N-cyclopentyl-N-methyl-1-(1…
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) | 3.29 | 8.42 | -133.68 | 4 | 2 | 2 | 32 | 270.42 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.29 | 8.1 | -31.43 | 3 | 2 | 1 | 30 | 269.412 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.29 | 7.18 | -48.91 | 3 | 2 | 1 | 31 | 269.412 | 4 | ↓ |