In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 12th, 2014 | 26 | Yes |
Popular Name: 5-methyl-N-[[(3S)-1-[(1-phenyltetrazol-5-yl)methyl]pyrrolidin-3-yl]methyl]pyridin-2-amine 5-methyl-N-[[(3S)-1-[(1-phenylte…
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) | 2.04 | 9.55 | -96.91 | 3 | 7 | 2 | 74 | 351.458 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.04 | 7.72 | -13.21 | 1 | 7 | 0 | 72 | 349.442 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.04 | 9.08 | -50.72 | 2 | 7 | 1 | 73 | 350.45 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.