In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 19 | Yes |
Popular Name: (2S)-2-[[(3S)-1-cyclopropylpyrrolidin-3-yl]amino]-1-(1-piperidyl)propan-1-one (2S)-2-[[(3S)-1-cyclopropylpyrro…
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) | 1.20 | 6.18 | -36.21 | 2 | 4 | 1 | 37 | 266.409 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.20 | 3.84 | -7.35 | 1 | 4 | 0 | 36 | 265.401 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.20 | 7.2 | -108.77 | 3 | 4 | 2 | 41 | 267.417 | 4 | ↓ |