In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 20 | No |
Popular Name: (3S)-1-cyclopropyl-N-[(1S)-1-(4-nitrophenyl)ethyl]pyrrolidin-3-amine (3S)-1-cyclopropyl-N-[(1S)-1-(4-…
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) | 2.53 | 8.64 | -40.12 | 2 | 5 | 1 | 62 | 276.36 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.53 | 6.3 | -5.97 | 1 | 5 | 0 | 61 | 275.352 | 5 | ↓ |