In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2010 | 16 | Yes |
Popular Name: (2S)-3-methyl-N1-[(1S,2R)-2-phenylcyclopropyl]butane-1,2-diamine (2S)-3-methyl-N1-[(1S,2R)-2-phen…
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) | 1.79 | 6.17 | -129.61 | 5 | 2 | 2 | 44 | 220.36 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.79 | 5.97 | -39.94 | 4 | 2 | 1 | 43 | 219.352 | 5 | ↓ |