In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 15 | Yes |
Popular Name: (3S)-1-isopropyl-N-(thiazol-2-ylmethyl)pyrrolidin-3-amine (3S)-1-isopropyl-N-(thiazol-2-yl…
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) | 0.98 | 4.06 | -34.44 | 2 | 3 | 1 | 29 | 226.369 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.98 | 1.6 | -4.57 | 1 | 3 | 0 | 28 | 225.361 | 4 | ↓ |