In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 17 | Yes |
Popular Name: (3S)-N-[(1S)-1-(5-chloro-2-thienyl)ethyl]-1-isopropyl-pyrrolidin-3-amine (3S)-N-[(1S)-1-(5-chloro-2-thien…
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) | 3.58 | 7.2 | -32.99 | 2 | 2 | 1 | 16 | 273.853 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.58 | 4.87 | -1.7 | 1 | 2 | 0 | 15 | 272.845 | 4 | ↓ |