In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2011 | 14 | Yes |
Popular Name: (4S)-4-amino-1-[(1S)-1-(cyclopropylmethyl)propyl]pyrrolidin-2-one (4S)-4-amino-1-[(1S)-1-(cyclopro…
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) | 0.66 | 4.79 | -55.92 | 3 | 3 | 1 | 48 | 197.302 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.66 | 4.49 | -8.13 | 2 | 3 | 0 | 46 | 196.294 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.